2-[2-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-3H-isoindol-1-one

Systemtic Name: 2-[2-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-3H-isoindol-1-one Openeye Name: 2-[2-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]-2-oxo-ethyl]isoindolin-1-one CAS Name: 2-[2-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-2-oxoethyl]-3H-isoindol-1-one IUPAC Name: 2-[2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-oxoethyl]-3H-isoindol-1-one Traditional Name: 2-[2-[4-(5-chloro-2-methyl-phenyl)piperazino]-2-keto-ethyl]isoindolin-1-one Formula: C21H22ClN3O2 MolecularWeight: 383.87128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)CN3CC4=CC=CC=C4C3=O

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)CN3CC4=CC=CC=C4C3=O

InChI

InChI=1S/C21H22ClN3O2/c1-15-6-7-17(22)12-19(15)23-8-10-24(11-9-23)20(26)14-25-13-16-4-2-3-5-18(16)21(25)27/h2-7,12H,8-11,13-14H2,1H3